Carbanilic acid, 4-bromo-3-chlorodithio-, allyl ester
TL;DR: Carbanilic acid, 4-bromo-3-chlorodithio-, allyl ester (CAS 19079-21-1) is a chemical compound with molecular formula C10H9BrClNS2 and molecular weight 320.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
prop-2-enyl N-(4-bromo-3-chlorophenyl)carbamodithioate
Also Known As: Allyl 4-bromo-3-chlorodithiocarbanilate, 4-Bromo-3-chlorodithiocarbanilic acid allyl ester, CARBANILIC ACID, 4-BROMO-3-CHLORODITHIO-, ALLYL ESTER, Prop-2-en-1-yl (4-bromo-3-chlorophenyl)carbamodithioate, prop-2-enyl N-(4-bromo-3-chlorophenyl)carbamodithioate
| Molecular Formula | C10H9BrClNS2 |
|---|---|
| Molecular Weight | 320.90 g/mol |
| LogP | 4.7185 |
| Topological Polar Surface Area | 12.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 320.90482 |
| Heavy Atoms | 15 |
| Complexity | 381.68518 |
Chemical Identifiers
| CAS Number | 19079-21-1 |
|---|---|
| SMILES | C=CCSC(=S)NC1=CC(=C(C=C1)Br)Cl |
Product Overview
Carbanilic acid, 4-bromo-3-chlorodithio-, allyl ester (CAS 19079-21-1), with molecular formula C10H9BrClNS2 and molecular weight 320.90 g/mol. IUPAC: prop-2-enyl N-(4-bromo-3-chlorophenyl)carbamodithioate.
Chemical Property Profile of Carbanilic acid, 4-bromo-3-chlorodithio-, allyl ester
Property Insights of Carbanilic acid, 4-bromo-3-chlorodithio-, allyl ester
The XLogP value of 4.7185 indicates that Carbanilic acid, 4-bromo-3-chlorodithio-, allyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.03 Ų, Carbanilic acid, 4-bromo-3-chlorodithio-, allyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Carbanilic acid, 4-bromo-3-chlorodithio-, allyl ester has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Carbanilic acid, 4-bromo-3-chlorodithio-, allyl ester?
The CAS number of Carbanilic acid, 4-bromo-3-chlorodithio-, allyl ester is 19079-21-1.
What is the molecular formula of Carbanilic acid, 4-bromo-3-chlorodithio-, allyl ester?
The molecular formula of Carbanilic acid, 4-bromo-3-chlorodithio-, allyl ester is C10H9BrClNS2.
What is the molecular weight of Carbanilic acid, 4-bromo-3-chlorodithio-, allyl ester?
The molecular weight of Carbanilic acid, 4-bromo-3-chlorodithio-, allyl ester is 320.90 g/mol.
Where can I buy Carbanilic acid, 4-bromo-3-chlorodithio-, allyl ester?
You can request a quote for Carbanilic acid, 4-bromo-3-chlorodithio-, allyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbanilic acid, 4-bromo-3-chlorodithio-, allyl ester?
Yes, KEHONG BIO provides custom synthesis services for Carbanilic acid, 4-bromo-3-chlorodithio-, allyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.